SCHEMBL33155

SCHEMBL33155

C[C@H]1CN(S(=O)(=O)c2ccccc2)CCN1c1ccc(O)cc1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.51
POLB P06746 3/20 0.48
GCKR Q14397 2/20 0.47
ADAMTS5 Q9UNA0 3/20 0.47
MMP14 P50281 2/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
LMNA P02545 1/20 0.46
NAMPT P43490 1/20 0.46
PTGDR Q13258 1/20 0.46
RECQL P46063 1/20 0.45
BLM P54132 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL12088868 0.85 GCKR (0.54) SMN1; SMN2POLBGCKRADAMTS5MMP14
SCHEMBL19140 0.82 GCKR (0.71) GCKR
SCHEMBL16292 0.82 GCKR (0.71) GCKR
SCHEMBL5915301 0.82 MMP14 (0.54) SMN1; SMN2POLBADAMTS5MMP14L3MBTL1
SCHEMBL12078723 0.81 GCKR (0.61) GCKR
SCHEMBL16406 0.81 GCKR (0.61) GCKR
SCHEMBL33162 0.81 GCKR (0.61) GCKR
SCHEMBL17577 0.80 GCKR (0.44) SMN1; SMN2POLBGCKRADAMTS5MMP14
SCHEMBL17330 0.80 GCKR (0.72) GCKR
SCHEMBL33150 0.76 GCKR (0.48) SMN1; SMN2POLBGCKRADAMTS5MMP14

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8431563-B2 Compounds that interact with glucokinase regulatory protein for the treatment of diabetes AMGEN INC. (US) 2013-04-30 US disclosed
US-20120225854-A1 COMPOUNDS THAT INTERACT WITH GLUCOKINASE REGULATORY PROTEIN FOR THE TREATMENT OF DIABETES AMGEN INC. (US) 2012-09-06 US disclosed
WO-2012027261-A1 SULFONYLPIPERAZINE DERIVATIVES THAT INTERACT WITH GLUCOKINASE REGULATORY PROTEIN FOR THE TREATMENT OF DIABETES AMGEN INC. (US) 2012-03-01 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120225854-A1 COMPOUNDS THAT INTERACT WITH GLUCOKINASE REGULATORY PROTEIN FOR THE TREATMENT OF DIABETES GCKR, GCK, SLC5A2 SMN1; SMN2 4413/4885POLB 4613/4885GCKR 1/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.